SCHEMBL6909434

SCHEMBL6909434

Oc1ccccc1N=C=Nc1ccccc1O

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.59
MEN1 O00255 6/20 0.59
KMT2A Q03164 6/20 0.59
NPC1 O15118 5/20 0.59
SMN1; SMN2 Q16637 5/20 0.59
LMNA P02545 4/20 0.59
HTT P42858 4/20 0.59
KDM4E B2RXH2 3/20 0.59
ALDH1A1 P00352 4/20 0.45
RAB9A P51151 4/20 0.45
L3MBTL1 Q9Y468 4/20 0.45
POLB P06746 3/20 0.45
CA12 O43570 2/20 0.45
CA2 P00918 2/20 0.45
HSD17B10 Q99714 2/20 0.45
ALOX15 P16050 2/20 0.45
GMNN O75496 1/20 0.45
EGFR P00533 1/20 0.45
FYN P06241 1/20 0.45
CA3 P07451 1/20 0.45

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL28625989 0.88 MAPT (0.52) MAPTMEN1KMT2ANPC1SMN1; SMN2
SCHEMBL29610896 0.80 MAPT (0.54) MAPTMEN1KMT2ANPC1SMN1; SMN2
SCHEMBL12098459 0.80 MAPT (0.54) MAPTMEN1KMT2ANPC1SMN1; SMN2
SCHEMBL632309 0.80 SMN1; SMN2 (0.54) MAPTMEN1KMT2ANPC1SMN1; SMN2
SCHEMBL4320644 0.80 MAPT (0.54) MAPTMEN1KMT2ANPC1SMN1; SMN2
SCHEMBL5462389 0.76
SCHEMBL28689342 0.75 SMN1; SMN2 (0.48) MAPTMEN1KMT2ANPC1SMN1; SMN2
SCHEMBL574042 0.75 MAPT (1.00) MAPTMEN1KMT2ANPC1SMN1; SMN2
SCHEMBL131175 0.75 MAPT (1.00) MAPTMEN1KMT2ANPC1SMN1; SMN2
SCHEMBL304890 0.75 MAPT (0.68) MAPTMEN1KMT2ANPC1SMN1; SMN2

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 10 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6479438-B2 USEFUL AGROCHEMICAL SOLUTIONS AND ADDITIONALLY HAVE SEVERAL OTHER NON-AGROCHEMICAL USES INCLUDING DILUENTS FOR FORMING OIL-IN-WATER (O/W) OR WATER-IN-OIL (W/O) MICROEMULSIONS FOR CLEANING AND DISINFECTING FORMULATIONS, PESTICIDAL SPRAYS ISP INVESTMENTS INC. 2002-11-12 US claimed
US-20020128153-A1 Gel inhibited liquid carrier for a biocide containing a carbodiimide and an emulsifier mixture ISP INVESTMENTS INC. 2002-09-12 US claimed
WO-2002052938-A1 GEL INHIBITED LIQUID CARRIER FOR A BIOCIDE CONTAINING A CARBODIIMIDE AND AN EMULSIFIER MIXTURE ISP INVESTMENTS INC. (US) 2002-07-11 WO claimed
US-20140166106-A1 SOLAR CELL BACK-SHEET AND SOLAR CELL MODULE FUJIFILM CORPORATION (JP) 2014-06-19 US disclosed
US-6767548-B2 STABILIZED CONCENTRATES CONTAINING MICROBIOCIDESM MIXTURE OF OIL, CARDIIMIDE COMPOUND AND EMULSIFIER ISP INVESTMENTS INC. 2004-07-27 US disclosed
US-20030165554-A1 Gel inhibited liquid carrier for a biocide containing a carbodiimide and an emulsifier mixture ISP INVESTMENTS INC. 2003-09-04 US disclosed
WO-2003069992-A1 GEL INHIBITED LIQUID CARRIER FOR A BIOCIDE CONTAINING A CARBODIIMIDE AND AN EMULSIFIER MIXTURE ISP INVESTMENTS INC. (US) 2003-08-28 WO disclosed
US-6479438-B2 USEFUL AGROCHEMICAL SOLUTIONS AND ADDITIONALLY HAVE SEVERAL OTHER NON-AGROCHEMICAL USES INCLUDING DILUENTS FOR FORMING OIL-IN-WATER (O/W) OR WATER-IN-OIL (W/O) MICROEMULSIONS FOR CLEANING AND DISINFECTING FORMULATIONS, PESTICIDAL SPRAYS ISP INVESTMENTS INC. 2002-11-12 US disclosed
US-20020128153-A1 Gel inhibited liquid carrier for a biocide containing a carbodiimide and an emulsifier mixture ISP INVESTMENTS INC. 2002-09-12 US disclosed
WO-2002052938-A1 GEL INHIBITED LIQUID CARRIER FOR A BIOCIDE CONTAINING A CARBODIIMIDE AND AN EMULSIFIER MIXTURE ISP INVESTMENTS INC. (US) 2002-07-11 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20030165554-A1 Gel inhibited liquid carrier for a biocide containing a carbodiimide and an emulsifier mixture HAO2, HAAO, ALOX12 MAPT 4792/4885MEN1 4773/4885KMT2A 2321/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.